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Information card for entry 1571166
Preview
| Coordinates | 1571166.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | 4-Fluoro-2-(phenylamino)benzoic acid |
|---|---|
| Formula | C13 H10 F N O2 |
| Calculated formula | C13 H10 F N O2 |
| Title of publication | 4-Fluoro-2-(phenylamino)benzoic acid |
| Authors of publication | Li, Jingxi; Long, Sihui |
| Journal of publication | IUCrData |
| Year of publication | 2024 |
| Journal volume | 9 |
| Journal issue | 3 |
| a | 9.955 ± 0.0003 Å |
| b | 10.006 ± 0.0003 Å |
| c | 11.332 ± 0.0004 Å |
| α | 89.415 ± 0.0014° |
| β | 78.013 ± 0.0014° |
| γ | 78.901 ± 0.0014° |
| Cell volume | 1082.99 ± 0.06 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1177 |
| Residual factor for significantly intense reflections | 0.0503 |
| Weighted residual factors for significantly intense reflections | 0.1068 |
| Weighted residual factors for all reflections included in the refinement | 0.1314 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.944 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 290376 (current) | 2024-03-07 | cif/ Adding structures of 1571166 via cif-deposit CGI script. |
1571166.cif |
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